ethane;trihydroxy(diphenyl)-λ5-phosphane

C14H19O3P — CID 159842008

IUPACethane;trihydroxy(diphenyl)-λ5-phosphane
SMILESCC.OP(O)(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H13O3P.C2H6/c13-16(14,15,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2/h1-10,13-15H;1-2H3
InChIKeyNOUJMYVHRYZPKT-UHFFFAOYSA-N
MW266.28 g/mol
LogP1.94
Rot. Bonds2

About ethane;trihydroxy(diphenyl)-λ5-phosphane

ethane;trihydroxy(diphenyl)-λ5-phosphane (PubChem CID 159842008) has the molecular formula C14H19O3P and a molecular weight of 266.28 g/mol. Its IUPAC name is ethane;trihydroxy(diphenyl)-λ5-phosphane.

Molecular Properties

Compound Nameethane;trihydroxy(diphenyl)-λ5-phosphane
PubChem CID159842008
Molecular FormulaC14H19O3P
Molecular Weight266.28 g/mol
Exact Mass266.11
IUPAC Nameethane;trihydroxy(diphenyl)-λ5-phosphane
SMILESCC.OP(O)(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H13O3P.C2H6/c13-16(14,15,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2/h1-10,13-15H;1-2H3
InChIKeyNOUJMYVHRYZPKT-UHFFFAOYSA-N
XLogP1.94
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 51.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

ruthenium;trihydroxy-methoxy-phenyl-λ5-phosphane
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CID 71339905
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difluoro-methyl-diphenyl-λ5-phosphane
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diphenylmethanimine;ethane
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benzene;ethane;methanol;naphthalene
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ethane;phenol
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bromo-(1-bromoethyl)-triphenyl-lambda5-phosphane
CID 14002017
bromo-[2-(bromomethyl)phenyl]-methyl-diphenyl-λ5-phosphane
CID 135051319
bromo-methyl-triphenyl-λ5-phosphane;hydrobromide
CID 173269490
benzene;1,1'-biphenyl;ethane
CID 158550617
bis(2-chloroethyl)-dihydroxy-phenyl-λ5-phosphane
CID 57282353
dodecyl-trihydroxy-phenyl-λ5-phosphane
CID 57297233

Frequently Asked Questions

What is the IUPAC name of ethane;trihydroxy(diphenyl)-λ5-phosphane?
The IUPAC name of ethane;trihydroxy(diphenyl)-λ5-phosphane (CID 159842008) is ethane;trihydroxy(diphenyl)-λ5-phosphane.
What is the SMILES notation for ethane;trihydroxy(diphenyl)-λ5-phosphane?
The canonical SMILES for ethane;trihydroxy(diphenyl)-λ5-phosphane is CC.OP(O)(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of ethane;trihydroxy(diphenyl)-λ5-phosphane?
The InChIKey is NOUJMYVHRYZPKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13O3P.C2H6/c13-16(14,15,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2/h1-10,13-15H;1-2H3.
What are the key properties of ethane;trihydroxy(diphenyl)-λ5-phosphane?
ethane;trihydroxy(diphenyl)-λ5-phosphane has a molecular weight of 266.28 g/mol, XLogP of 1.94, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;trihydroxy(diphenyl)-λ5-phosphane is sourced from PubChem (CID 159842008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).